UCSF

ZINC33825363

Annotations

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.48 5.49 -7.31 0 5 0 45 353.875 5
Mid Mid (pH 6-8) 2.48 6.42 -7.09 0 5 0 45 353.875 5
Mid Mid (pH 6-8) 2.48 7.88 -40.34 1 5 1 46 354.883 5
Mid Mid (pH 6-8) 2.48 8.69 -39.11 1 5 1 46 354.883 5

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )